SCHEMBL8515221

SCHEMBL8515221

O=C(O)N[C@@]1(c2ccccc2F)COC[C@H]1CO

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
HDAC4 P56524 7/20 0.35
HCAR2 Q8TDS4 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DPP4 P27487 1/20 0.32
PTPN1 P18031 1/20 0.32
ERCC5 P28715 1/20 0.32
FEN1 P39748 1/20 0.32
CHRNA7 P36544 1/20 0.32
FKBP1A P62942 1/20 0.32
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
EPHX2 P34913 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8515218 1.00 BACE1 (0.35) BACE1BACE2HDAC4HCAR2MEN1
SCHEMBL2111012 0.84 EPHX1 (0.44) MEN1ALDH1A1KMT2A
SCHEMBL12693430 0.83 DPP8 (0.35) BACE1BACE2KMT2AL3MBTL1EPHX2
SCHEMBL6921038 0.83 DPP8 (0.35) BACE1BACE2KMT2AL3MBTL1EPHX2
SCHEMBL18498591 0.80 HDAC4 (0.35) BACE1BACE2HDAC4HCAR2ALDH1A1
SCHEMBL16292121 0.80 BACE1 (0.42) BACE1BACE2
SCHEMBL8515667 0.76 HCAR2 (0.36) BACE1BACE2HDAC4HCAR2HDAC9
SCHEMBL18517869 0.74 GPR119 (0.34) HDAC4EPHX2
SCHEMBL16976802 0.73 HDAC4 (0.33) BACE1BACE2HDAC4DPP4
SCHEMBL12689998 0.73 BACE1 (0.39) BACE1BACE2HDAC4HCAR2HCRTR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139594-B2 Fused aminodihydropyrimidone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-09-22 US disclosed
US-20120202828-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-08-09 US disclosed
EP-2456771-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2012-05-30 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120202828-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES BACE1, APP, BACE2 BACE1 1/4885BACE2 3/4885HDAC4 1989/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.